4-[hydroxymethyl(propyl)amino]benzenesulfonic acid

Systemtic Name: 4-[hydroxymethyl(propyl)amino]benzenesulfonic acid Openeye Name: 4-[hydroxymethyl(propyl)amino]benzenesulfonic acid CAS Name: 4-[hydroxymethyl(propyl)amino]benzenesulfonic acid IUPAC Name: 4-[hydroxymethyl(propyl)amino]benzenesulfonic acid Traditional Name: 4-[methylol(propyl)amino]besylic acid Formula: C10H15NO4S MolecularWeight: 245.2954

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CO)C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCN(CO)C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C10H15NO4S/c1-2-7-11(8-12)9-3-5-10(6-4-9)16(13,14)15/h3-6,12H,2,7-8H2,1H3,(H,13,14,15)